| SpectraBase Spectrum ID |
AKlMsa35GSb |
| Name |
3-Methyl-3,4-dihydroxy-4-phenyl-1-butyne |
| CAS Registry Number |
2033-94-5 |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
162.068079560 u |
| Formula |
C10H10O2 |
| InChI |
InChI=1S/C10H10O2/c1-2-9(11)10(12)8-6-4-3-5-7-8/h1,3-7,9-12H |
| InChIKey |
KFMCJUFHGIJNKJ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
162.188 g/mol |
| Nominal Mass |
162 u |
| Quality |
937 |
| Retention Index |
1147 |
| SMILES |
OC(C(C1=CC=CC=C1)O)C#C |
| SPLASH |
splash10-0a6r-9400000000-493308965e93228f068a |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-phenylbut-3-yne-1,2-diol |
| Technique |
GC/MS |
| Wiley ID |
DD2024_002103 |
